Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 2/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.49 |
| ▸ | KDM1A | O60341 | 7/20 | 0.46 |
| ▸ | CHRM2 | P08172 | 3/20 | 0.44 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.44 |
| ▸ | CHRM3 | P20309 | 2/20 | 0.44 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.44 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.44 |
| ▸ | DRD1 | P21728 | 2/20 | 0.44 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.44 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.44 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.44 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.44 |
| ▸ | DRD3 | P35462 | 2/20 | 0.44 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.44 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.44 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.44 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.44 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.44 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.44 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL11239038 | 0.86 | PIM1 (0.46) | CYP2D6CYP1A2KDM1ACHRM2SIGMAR1 | |
| SCHEMBL11098037 | 0.86 | DRD2 (0.49) | CYP2D6CYP1A2CHRM2SIGMAR1CHRM3 | |
| SCHEMBL11241659 | 0.86 | CYP1A2 (0.42) | CYP2D6CYP1A2KDM1ACHRM2SIGMAR1 | |
| SCHEMBL11247293 | 0.82 | HTR2C (0.49) | KDM1ASIGMAR1HTR2AHTR2CHTR2B | |
| SCHEMBL9611568 | 0.80 | CYP2D6 (0.55) | CYP2D6CYP1A2KDM1ACHRM2SIGMAR1 | |
| SCHEMBL11103752 | 0.77 | HTR2A (0.49) | CYP2D6CYP1A2CHRM2CHRM3ADRA2A | |
| SCHEMBL17933519 | 0.74 | MAOA (0.55) | CYP2D6CYP1A2KDM1ACHRM2SIGMAR1 | |
| SCHEMBL11256455 | 0.73 | P2RX4 (0.48) | CYP2D6CYP1A2CHRM2CHRM3OPRM1 | |
| SCHEMBL11633335 | 0.73 | MAOA (0.50) | CYP2D6CYP1A2KDM1ACHRM2SIGMAR1 | |
| SCHEMBL11246866 | 0.72 | MAPT (0.56) | CYP2D6CYP1A2KDM1ACHRM2SIGMAR1 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4360525-A | NEUROLEPTIC AGENTS, ANTIDEPRESSANTS, SLEEP PROMOTERS | SANDOZ LTD. (CH) | 1982-11-23 | — | — | US | claimed |